(2Z)-2-(phenylmethylidene)-N-[1-[1-(phenylmethyl)piperazin-1-ium-1-yl]propoxy]cyclohexan-1-imine

Systemtic Name: (2Z)-2-(phenylmethylidene)-N-[1-[1-(phenylmethyl)piperazin-1-ium-1-yl]propoxy]cyclohexan-1-imine Openeye Name: (2Z)-2-benzylidene-N-[1-(1-benzylpiperazin-1-ium-1-yl)propoxy]cyclohexanimine CAS Name: (2Z)-2-(phenylmethylene)-N-[1-[1-(phenylmethyl)-1-piperazin-1-iumyl]propoxy]-1-cyclohexanimine IUPAC Name: (2Z)-2-benzylidene-N-[1-(1-benzylpiperazin-1-ium-1-yl)propoxy]cyclohexan-1-imine Traditional Name: (E)-[(2Z)-2-benzalcyclohexylidene]-[1-(1-benzylpiperazin-1-ium-1-yl)propoxy]amine Formula: C27H36N3O+ MolecularWeight: 418.59424

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Descriptors Computed from Structure

Canonical SMILES:

CCC([N+]1(CCNCC1)CC2=CC=CC=C2)ON=C3CCCCC3=CC4=CC=CC=C4

Isomeric SMILES

CCC([N+]1(CCNCC1)CC2=CC=CC=C2)O/N=C/3\CCCC\C3=C\C4=CC=CC=C4

InChI

InChI=1S/C27H36N3O/c1-2-27(30(19-17-28-18-20-30)22-24-13-7-4-8-14-24)31-29-26-16-10-9-15-25(26)21-23-11-5-3-6-12-23/h3-8,11-14,21,27-28H,2,9-10,15-20,22H2,1H3/q+1/b25-21-,29-26+